Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.41 |
| ▸ | HTR7 | P34969 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 2/20 | 0.39 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | GFER | P55789 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | PAX8 | Q06710 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | GPX4 | P36969 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 5/20 | 0.38 |
| ▸ | S100B | P04271 | 1/20 | 0.38 |
| ▸ | JAK2 | O60674 | 1/20 | 0.37 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL16617890 | 1.00 | TSHR (0.47) | TSHRALDH1A1CYP3A4TDP1KDM4E | |
| SCHEMBL16617376 | 0.98 | TSHR (0.45) | TSHRALDH1A1CYP3A4TDP1KDM4E | |
| SCHEMBL1498662 | 0.93 | TSHR (0.50) | TSHRALDH1A1CYP3A4KDM4EKCNH2 | |
| SCHEMBL16618153 | 0.93 | CYP3A4 (0.44) | TSHRALDH1A1CYP3A4TDP1KDM4E | |
| SCHEMBL3664908 | 0.92 | TSHR (0.47) | TSHRALDH1A1CYP3A4KDM4EKCNH2 | |
| SCHEMBL1498625 | 0.86 | TSHR (0.45) | TSHRALDH1A1CYP3A4KDM4EHTR7 | |
| SCHEMBL16617493 | 0.86 | CYP3A4 (0.47) | TSHRALDH1A1CYP3A4TDP1RECQL | |
| SCHEMBL16617357 | 0.83 | TSHR (0.42) | TSHRALDH1A1CYP3A4KDM4EHTR7 | |
| SCHEMBL1413227 | 0.82 | ALDH1A1 (0.59) | TSHRALDH1A1CYP3A4TDP1RECQL | |
| SCHEMBL29931735 | 0.82 | ALDH1A1 (0.59) | TSHRALDH1A1CYP3A4TDP1RECQL |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2828339-B1 | CARBOXYLATE DYES | MILLIKEN & CO (US) | 2018-10-31 | — | — | EP | disclosed |
| US-9187717-B2 | Carboxylate dyes | MILLIKEN & COMPANY (US) | 2015-11-17 | — | — | US | disclosed |
| US-20150099869-A1 | Carboxylate Dyes | MILLIKEN & COMPANY | 2015-04-09 | — | — | US | disclosed |